1-(1,3-benzodioxol-5-yl)-3-[2-(4-bromanylpyrazol-1-yl)ethyl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(4-bromanylpyrazol-1-yl)ethyl]urea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(4-bromopyrazol-1-yl)ethyl]urea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(4-bromo-1-pyrazolyl)ethyl]urea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(4-bromopyrazol-1-yl)ethyl]urea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(4-bromopyrazol-1-yl)ethyl]urea Formula: C13H13BrN4O3 MolecularWeight: 353.17132

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)NCCN3C=C(C=N3)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)NCCN3C=C(C=N3)Br

InChI

InChI=1S/C13H13BrN4O3/c14-9-6-16-18(7-9)4-3-15-13(19)17-10-1-2-11-12(5-10)21-8-20-11/h1-2,5-7H,3-4,8H2,(H2,15,17,19)